N'-benzyl-N-methyl-N-(2-{5-[1-(propan-2-yl)-1,4,6,7-tetrahydropyrano[4,3-c]pyrazol-3-yl]-1,2,4-oxadiazol-3-yl}ethyl)urea
Chemical Structure Depiction of
N'-benzyl-N-methyl-N-(2-{5-[1-(propan-2-yl)-1,4,6,7-tetrahydropyrano[4,3-c]pyrazol-3-yl]-1,2,4-oxadiazol-3-yl}ethyl)urea
N'-benzyl-N-methyl-N-(2-{5-[1-(propan-2-yl)-1,4,6,7-tetrahydropyrano[4,3-c]pyrazol-3-yl]-1,2,4-oxadiazol-3-yl}ethyl)urea
Compound characteristics
| Compound ID: | SC01-0156 |
| Compound Name: | N'-benzyl-N-methyl-N-(2-{5-[1-(propan-2-yl)-1,4,6,7-tetrahydropyrano[4,3-c]pyrazol-3-yl]-1,2,4-oxadiazol-3-yl}ethyl)urea |
| Molecular Weight: | 424.5 |
| Molecular Formula: | C22 H28 N6 O3 |
| Smiles: | CC(C)n1c2CCOCc2c(c2nc(CCN(C)C(NCc3ccccc3)=O)no2)n1 |
| Stereo: | ACHIRAL |
| logP: | 2.08 |
| logD: | 2.08 |
| logSw: | -2.4904 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 82.705 |
| InChI Key: | QQJIYHGFXYELSN-UHFFFAOYSA-N |